1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(3-pyridylmethyl)pyrrolidine-2-carboxamide CAS Name: 1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-N-(3-pyridinylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(3-pyridylmethyl)pyrrolidine-2-carboxamide Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC(=NS2)CC3=CC=CC=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CC(N(C1)C2=NC(=NS2)CC3=CC=CC=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C20H21N5OS/c26-19(22-14-16-8-4-10-21-13-16)17-9-5-11-25(17)20-23-18(24-27-20)12-15-6-2-1-3-7-15/h1-4,6-8,10,13,17H,5,9,11-12,14H2,(H,22,26)